COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428092
Chemical Name: (5E)-3-benzyl-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])/C(=O)N1Cc1ccccc1

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Molecular Weight: 421.5
Empirical Formula: C21H15N3O3S2

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 4.29
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 128
Number of rings: 4

     

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